1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine
TL;DR: 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine (CAS 449764-60-7) is a chemical compound with molecular formula C16H22N2OS and molecular weight 290.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-thiophen-2-ylmethanone
Also Known As: 1-(3-cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine, AT-057/43316687, 4-(cyclohex-3-enylmethyl)piperazinyl 2-thienyl ketone, [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl](thiophen-2-yl)methanone, [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-thiophen-2-ylmethanone
| Molecular Formula | C16H22N2OS |
|---|---|
| Molecular Weight | 290.15 g/mol |
| LogP | 2.8622 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.1453 |
| Heavy Atoms | 20 |
| Complexity | 460.83124 |
Chemical Identifiers
| CAS Number | 449764-60-7 |
|---|---|
| SMILES | C1CC(CC=C1)CN2CCN(CC2)C(=O)C3=CC=CS3 |
Product Overview
1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine (CAS 449764-60-7), with molecular formula C16H22N2OS and molecular weight 290.15 g/mol. IUPAC: [4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine
Property Insights of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine
The XLogP value of 2.8622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine. With a topological polar surface area (TPSA) of 23.55 Ų, 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine?
The CAS number of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine is 449764-60-7.
What is the molecular formula of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine?
The molecular formula of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine is C16H22N2OS.
What is the molecular weight of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine?
The molecular weight of 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine is 290.15 g/mol.
Where can I buy 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine?
You can request a quote for 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Cyclohexen-1-ylmethyl)-4-(2-thienylcarbonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.